methyl 2-[[13-(2-methoxycarbonylphenyl)carbonyl-1,4,10-trioxa-7,13-diazacyclopentadec-7-yl]carbonyl]benzoate

Systemtic Name: methyl 2-[[13-(2-methoxycarbonylphenyl)carbonyl-1,4,10-trioxa-7,13-diazacyclopentadec-7-yl]carbonyl]benzoate Openeye Name: methyl 2-[13-(2-methoxycarbonylbenzoyl)-1,4,10-trioxa-7,13-diazacyclopentadecane-7-carbonyl]benzoate CAS Name: 2-[[13-[(2-methoxycarbonylphenyl)-oxomethyl]-1,4,10-trioxa-7,13-diazacyclopentadec-7-yl]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[13-(2-methoxycarbonylbenzoyl)-1,4,10-trioxa-7,13-diazacyclopentadecane-7-carbonyl]benzoate Traditional Name: 2-[13-(2-carbomethoxybenzoyl)-1,4,10-trioxa-7,13-diazacyclopentadecane-7-carbonyl]benzoic acid methyl ester Formula: C28H34N2O9 MolecularWeight: 542.57756

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C(=O)N2CCOCCN(CCOCCOCC2)C(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

COC(=O)C1=CC=CC=C1C(=O)N2CCOCCN(CCOCCOCC2)C(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C28H34N2O9/c1-35-27(33)23-9-5-3-7-21(23)25(31)29-11-15-37-16-12-30(14-18-39-20-19-38-17-13-29)26(32)22-8-4-6-10-24(22)28(34)36-2/h3-10H,11-20H2,1-2H3